Dibromobutadiyne
TL;DR: Dibromobutadiyne (CAS 36333-41-2) is a chemical compound with molecular formula C4Br2 and molecular weight 205.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dibromobuta-1,3-diyne
Also Known As: Dibromobutadiyne, dibromodiacetylene, dibromobuta-1,3-diyne, 1,4-dibromobuta-1,3-diyne, 1,3-Butadiyne, 1,4-dibromo-
| Molecular Formula | C4Br2 |
|---|---|
| Molecular Weight | 205.84 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.83669 |
| Heavy Atoms | 6 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 36333-41-2 |
|---|---|
| SMILES | C(#CBr)C#CBr |
| InChIKey | WTNKPRUJYFZQFT-UHFFFAOYSA-N |
Product Overview
Dibromobutadiyne (CAS 36333-41-2), with molecular formula C4Br2 and molecular weight 205.84 g/mol. IUPAC: 1,4-dibromobuta-1,3-diyne.
Chemical Property Profile of Dibromobutadiyne
Property Insights of Dibromobutadiyne
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibromobutadiyne. With a topological polar surface area (TPSA) of 0.0 Ų, Dibromobutadiyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibromobutadiyne has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibromobutadiyne?
The CAS number of Dibromobutadiyne is 36333-41-2.
What is the molecular formula of Dibromobutadiyne?
The molecular formula of Dibromobutadiyne is C4Br2.
What is the molecular weight of Dibromobutadiyne?
The molecular weight of Dibromobutadiyne is 205.84 g/mol.
Where can I buy Dibromobutadiyne?
You can request a quote for Dibromobutadiyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibromobutadiyne?
Yes, KEHONG BIO provides custom synthesis services for Dibromobutadiyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.